⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1997632 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL1992090 | 0.99 | — | — | |
| Hydrochloric Acid SCHEMBL29538149 | 0.99 | — | — | |
| SCHEMBL1993882 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL1995736 | 0.92 | — | — | |
| SCHEMBL6919539 | 0.90 | — | — | |
| SCHEMBL29536702 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL1993734 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL29537798 | 0.89 | — | — | |
| SCHEMBL1992426 | 0.86 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3187490-B1 | SUBSTITUTED BENZAMIDE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2022-04-06 | — | — | EP | claimed |